Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAOA | P21397 | 5/20 | 0.41 |
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | MGMT | P16455 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | PLAU | P00749 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | FABP7 | O15540 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8625967 | 0.84 | MAOA (0.36) | ALDH1A1MAOAMAOBCES1MAPK1 | |
| SCHEMBL8623551 | 0.84 | MAOA (0.38) | ALDH1A1MAOAMAOBCES1CDK1 | |
| SCHEMBL3752087 | 0.83 | MAOA (0.50) | ALDH1A1MAOAMAOBCES1MAPK1 | |
| SCHEMBL4342386 | 0.83 | ALDH1A1 (0.49) | ALDH1A1CES1MAPK1HIF1APOLB | |
| SCHEMBL5030638 | 0.81 | MAOA (0.33) | ALDH1A1MAOAMAOBCES1MAPK1 | |
| SCHEMBL27591269 | 0.78 | MAOA (0.42) | MAOAMAOBCES1MAPK1HIF1A | |
| SCHEMBL5644297 | 0.77 | TACR1 (0.52) | — | |
| SCHEMBL9010870 | 0.77 | ALDH1A1 (0.39) | ALDH1A1CES1MAPK1HIF1AESR1 | |
| SCHEMBL194628 | 0.76 | ALDH1A1 (0.44) | ALDH1A1MAOAMAOBPOLB | |
| SCHEMBL7792764 | 0.75 | ESR1 (0.47) | MAOAMAOBCES1MAPK1ESR1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5786434-A | A CURABLE COPOLYMER COMPRISING A DIALKYLACRYLAMIDE OR METHACRYLAMIDE, A VINYLLACTAM, A BIS(SILICON-CONTAINING ALKYL)FUMARATE MONOMERS; RADIATION TRANSPARENT, HIGH OXYGEN PERMEABILITY | MENICON CO., LTD. (JP) | 1998-07-28 | — | — | US | disclosed |